SCHEMBL9303310

SCHEMBL9303310

CC(C)N(C=O)S(=O)(=O)c1cccc(N)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.50
▸ CA2 P00918 4/20 0.49
▸ CA12 O43570 3/20 0.49
▸ CA1 P00915 3/20 0.49
▸ CA9 Q16790 3/20 0.49
▸ CA4 P22748 2/20 0.49
▸ CA14 Q9ULX7 1/20 0.49
▸ ALDH1A1 P00352 2/20 0.47
▸ TSHR P16473 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ CYP19A1 P11511 1/20 0.42
▸ F2 P00734 3/20 0.41
▸ PRSS1 P07477 3/20 0.41
▸ PRSS2 P07478 3/20 0.41
▸ PRSS3 P35030 3/20 0.41
▸ POLB P06746 2/20 0.41
▸ PRMT1 Q99873 1/20 0.39
▸ PKM P14618 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4070721 0.78 LMNA (0.55) LMNACA2CA12CA1CA9
SCHEMBL519750 0.75 LMNA (0.61) LMNACA2CA12CA1CA9
SCHEMBL9306186 0.73 LMNA (0.49) LMNACA2CA12CA1CA9
SCHEMBL20930301 0.72 ALDH1A1 (0.49) LMNACA2CA12CA1CA9
SCHEMBL2868837 0.72 LMNA (0.61) LMNACA2CA12CA1CA9
SCHEMBL30764017 0.72 LMNA (0.61) LMNACA2CA12CA1CA9
SCHEMBL29405930 0.71 ALDH1A1 (0.69) LMNACA2CA12CA1CA9
SCHEMBL2480051 0.71 ALDH1A1 (0.69) LMNACA2CA12CA1CA9
SCHEMBL10860489 0.71 LMNA (0.55) LMNACA2CA12CA1CA9
SCHEMBL8251507 0.70 LMNA (0.53) LMNACA2CA12CA1CA9

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5360802-A Antagonists of cholecystokinin and gastrin MERCK SHARPE & DOHME LTD. 1994-11-01 — — US disclosed
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